[(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methylpyridin-2-yl)methyl]azanium

Systemtic Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methylpyridin-2-yl)methyl]azanium Openeye Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methyl-2-pyridyl)methyl]ammonium CAS Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methyl-2-pyridinyl)methyl]ammonium IUPAC Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methylpyridin-2-yl)methyl]azanium Traditional Name: [(5S)-2-tert-butyl-7,7-dimethyl-6,8-dihydro-5H-quinazolin-5-yl]-[(6-methyl-2-pyridyl)methyl]ammonium Formula: C21H31N4+ MolecularWeight: 339.49764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH2+]C2CC(CC3=NC(=NC=C23)C(C)(C)C)(C)C

Isomeric SMILES

CC1=NC(=CC=C1)C[NH2+][C@H]2CC(CC3=NC(=NC=C23)C(C)(C)C)(C)C

InChI

InChI=1S/C21H30N4/c1-14-8-7-9-15(24-14)12-22-17-10-21(5,6)11-18-16(17)13-23-19(25-18)20(2,3)4/h7-9,13,17,22H,10-12H2,1-6H3/p+1/t17-/m0/s1